#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yrt s SER 2 N 0.00 -0.32 -0.19 1.61 0.15 -1.26 -5.16 113.70 108.53 2yrt s SER 2 Ca 0.00 0.61 -0.30 0.00 0.70 0.00 0.00 55.95 56.96 2yrt s SER 2 Cb 0.00 0.61 0.15 0.00 -1.71 0.00 0.00 66.02 65.07 2yrt s SER 2 CO 0.00 -0.11 1.12 -0.55 1.20 0.00 0.00 173.24 174.90 2yrt s SER 3 N 0.24 -0.25 -0.09 5.45 0.15 -1.26 -5.16 113.70 112.78 2yrt s SER 3 Ca -0.01 0.25 -0.03 0.00 0.70 0.00 0.00 55.95 56.87 2yrt s SER 3 Cb -0.03 0.21 0.05 0.00 -1.71 0.00 0.00 66.02 64.54 2yrt s SER 3 CO -0.00 -0.25 0.11 -0.83 1.20 0.00 0.00 173.24 173.47 2yrt s GLY 4 N -1.19 0.16 -0.75 9.45 0.00 -1.26 -5.10 107.32 108.64 2yrt s GLY 4 Ca 0.02 0.24 -0.19 0.00 0.00 0.00 0.00 44.72 44.79 2yrt s GLY 4 CO -0.02 1.60 0.93 -0.56 0.00 0.00 0.00 173.10 175.04 2yrt s SER 5 N 2.22 6.40 -0.06 1.64 0.01 -1.26 -5.02 113.70 117.62 2yrt s SER 5 Ca 0.04 -1.67 -0.03 0.00 1.31 0.00 0.00 55.95 55.60 2yrt s SER 5 Cb -0.13 -2.36 -0.04 0.00 0.21 0.00 0.00 66.02 63.71 2yrt s SER 5 CO -0.06 -1.13 0.09 -0.94 0.41 0.00 0.00 173.24 171.62 2yrt s SER 6 N 3.50 5.87 -0.21 2.44 1.04 -1.26 -5.01 113.70 120.07 2yrt s SER 6 Ca 0.22 0.27 0.13 0.00 0.48 0.00 0.00 55.95 57.05 2yrt s SER 6 Cb -0.14 -1.77 0.44 0.00 0.10 0.00 0.00 66.02 64.65 2yrt s SER 6 CO 0.00 0.34 1.31 0.61 0.98 0.00 0.00 173.24 176.48 2yrt n GLY 7 N 1.60 4.85 0.02 7.32 0.00 -1.26 -4.51 105.19 113.21 2yrt n GLY 7 Ca -0.16 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.66 2yrt n GLY 7 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2yrt n MET 8 N -1.10 1.32 -2.58 1.61 -0.00 -1.26 -5.00 117.12 110.10 2yrt n MET 8 Ca 0.23 -1.01 -0.41 0.00 -0.00 0.00 0.00 57.70 56.52 2yrt n MET 8 Cb 0.82 -0.74 -0.03 0.00 -0.00 0.00 0.00 33.22 33.27 2yrt n MET 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2yrt s ALA 9 N -0.51 2.77 0.19 3.17 0.00 -1.26 -3.91 121.76 122.21 2yrt s ALA 9 Ca 0.01 -1.72 -0.30 0.00 0.00 0.00 0.00 51.96 49.95 2yrt s ALA 9 Cb 0.01 -4.32 -0.08 0.00 0.00 0.00 0.00 23.12 18.73 2yrt s ALA 9 CO 0.00 -3.36 0.95 -0.51 0.00 0.00 0.00 175.76 172.84 2yrt s LEU 10 N 5.32 4.59 -0.16 0.00 1.43 0.17 -4.65 118.68 125.38 2yrt s LEU 10 Ca 0.38 1.91 -0.29 0.00 -1.03 0.00 0.00 54.13 55.09 2yrt s LEU 10 Cb -0.06 -3.60 -0.00 0.00 0.03 0.00 0.00 46.19 42.56 2yrt s LEU 10 CO 0.06 0.07 1.03 -0.22 0.23 0.00 0.00 176.35 177.52 2yrt s LEU 11 N -0.76 4.18 0.42 1.79 2.96 -1.26 -0.66 118.68 125.34 2yrt s LEU 11 Ca 0.43 1.47 -0.24 0.00 -0.22 0.00 0.00 54.13 55.58 2yrt s LEU 11 Cb -0.25 -3.55 -0.08 0.00 0.50 0.00 0.00 46.19 42.80 2yrt s LEU 11 CO 0.32 -0.56 1.09 0.00 -1.32 0.00 0.00 176.35 175.88 2yrt n TYR 13 N -0.18 0.76 -3.75 0.00 4.01 0.16 -3.87 117.16 114.29 2yrt n TYR 13 Ca 0.06 -1.54 -0.35 0.00 -0.16 0.00 0.00 57.90 55.90 2yrt n TYR 13 Cb 0.49 -0.25 -0.08 0.00 -0.31 0.00 0.00 39.34 39.19 2yrt n TYR 13 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 2yrt s ASN 14 N -3.15 6.17 -0.27 7.72 0.01 -1.26 -4.88 114.94 119.28 2yrt s ASN 14 Ca 0.39 0.22 -0.37 0.00 -0.71 0.00 0.00 52.86 52.39 2yrt s ASN 14 Cb 0.38 -2.08 -0.14 0.00 0.41 0.00 0.00 41.25 39.82 2yrt s ASN 14 CO -0.06 0.18 1.93 0.54 -1.51 0.00 0.00 177.10 178.18 2yrt n ARG 15 N 3.53 1.31 0.00 -0.60 1.74 -1.26 -0.06 116.66 121.32 2yrt n ARG 15 Ca -0.16 0.45 0.00 0.00 -0.77 0.00 0.00 57.85 57.37 2yrt n ARG 15 Cb 0.52 -2.32 0.00 0.00 -1.02 0.00 0.00 32.46 29.64 2yrt n ARG 15 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2yrt n GLY 16 N 5.11 1.81 0.42 -0.13 0.00 -1.26 0.38 105.19 111.51 2yrt n GLY 16 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.33 2yrt n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yrt n GLY 18 N 2.51 0.62 3.83 0.00 0.00 -1.11 -4.88 105.19 106.16 2yrt n GLY 18 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2yrt n GLY 18 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2yrt s GLN 19 N -2.43 2.56 0.95 1.61 -0.21 -1.26 -4.72 119.66 116.16 2yrt s GLN 19 Ca 0.00 -1.46 -0.14 0.00 0.02 0.00 0.00 55.36 53.78 2yrt s GLN 19 Cb 0.00 -2.36 0.16 0.00 1.00 0.00 0.00 33.01 31.82 2yrt s GLN 19 CO 0.00 -0.01 1.18 1.03 -2.12 0.00 0.00 175.29 175.37 2yrt s ARG 20 N -4.01 0.80 -0.05 2.91 1.81 -1.26 0.24 118.95 119.40 2yrt s ARG 20 Ca 0.43 0.07 -0.31 0.00 -1.72 0.00 0.00 55.73 54.20 2yrt s ARG 20 Cb -0.04 -1.82 0.11 0.00 -0.45 0.00 0.00 34.95 32.76 2yrt s ARG 20 CO 0.26 -2.38 1.12 -0.59 -0.68 0.00 0.00 175.30 173.03 2yrt s PHE 21 N -3.40 -0.15 -0.17 -0.53 -0.71 0.16 -4.73 117.98 108.44 2yrt s PHE 21 Ca 0.67 0.03 -0.05 0.00 -1.04 0.00 0.00 56.93 56.54 2yrt s PHE 21 Cb -0.11 0.55 -0.03 0.00 -1.21 0.00 0.00 43.02 42.21 2yrt s PHE 21 CO 0.53 -0.39 0.00 -0.51 -1.34 0.00 0.00 175.22 173.51 2yrt s ASP 22 N -2.57 5.04 0.08 1.98 1.11 -1.26 0.41 116.67 121.46 2yrt s ASP 22 Ca 0.10 -0.09 -0.16 0.00 0.18 0.00 0.00 52.55 52.58 2yrt s ASP 22 Cb 0.00 -1.84 -0.10 0.00 1.07 0.00 0.00 42.92 42.05 2yrt s ASP 22 CO -0.04 0.14 1.40 1.55 1.18 0.00 0.00 175.17 179.40 2yrt h PRO 23 N 6.90 0.61 0.00 8.23 0.13 -1.94 1.61 132.00 147.54 2yrt h PRO 23 Ca -0.34 -0.32 0.00 0.00 -0.87 0.00 0.00 66.00 64.47 2yrt h PRO 23 Cb 1.18 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2yrt h PRO 23 CO 0.64 0.92 0.00 -0.85 -0.23 0.00 0.00 178.00 178.48 2yrt n GLU 24 N -4.35 0.07 0.00 0.86 0.28 -1.26 -2.11 120.64 114.13 2yrt n GLU 24 Ca -0.04 0.50 0.00 0.00 -0.16 0.00 0.00 57.16 57.46 2yrt n GLU 24 Cb 0.44 -1.69 0.00 0.00 1.43 0.00 0.00 31.44 31.62 2yrt n GLU 24 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 2yrt n THR 25 N -1.83 0.00 -1.60 3.84 -2.24 -1.08 -5.06 114.28 106.31 2yrt n THR 25 Ca 0.00 -0.04 -0.46 0.00 -2.27 0.00 0.00 64.05 61.28 2yrt n THR 25 Cb 0.06 0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 68.76 2yrt n THR 25 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2yrt n ASN 26 N -1.26 1.52 -2.17 3.42 2.85 0.55 -4.98 115.26 115.19 2yrt n ASN 26 Ca 0.00 1.16 -0.10 0.00 -0.11 0.00 0.00 54.58 55.54 2yrt n ASN 26 Cb 0.00 -1.29 -0.03 0.00 1.24 0.00 0.00 39.78 39.70 2yrt n ASN 26 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2yrt n SER 27 N 1.60 -0.53 0.00 1.20 7.64 -1.26 -4.97 113.62 117.30 2yrt n SER 27 Ca 0.12 -2.14 0.13 0.00 1.01 0.00 0.00 58.87 57.99 2yrt n SER 27 Cb 0.29 1.11 0.70 0.00 -1.01 0.00 0.00 64.21 65.30 2yrt n SER 27 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2yrt n ASP 28 N -2.11 0.00 -1.91 6.43 2.03 -1.25 -2.59 116.55 117.15 2yrt n ASP 28 Ca 0.03 -0.14 -0.02 0.00 0.52 0.00 0.00 54.79 55.18 2yrt n ASP 28 Cb 0.33 -0.27 0.06 0.00 -0.72 0.00 0.00 41.12 40.52 2yrt n ASP 28 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2yrt n ASP 29 N -1.27 2.03 -0.00 1.67 5.75 -1.23 -0.41 116.55 123.09 2yrt n ASP 29 Ca 0.13 -2.64 0.00 0.00 -0.01 0.00 0.00 54.79 52.28 2yrt n ASP 29 Cb 0.21 -0.41 -0.00 0.00 -1.03 0.00 0.00 41.12 39.89 2yrt n ASP 29 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2yrt n ALA 30 N -0.36 2.02 -3.05 2.12 0.00 -1.13 -4.90 120.51 115.21 2yrt n ALA 30 Ca 0.15 -0.01 -0.32 0.00 0.00 0.00 0.00 53.44 53.26 2yrt n ALA 30 Cb 0.92 -0.01 -0.15 0.00 0.00 0.00 0.00 19.45 20.21 2yrt n ALA 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yrt s THR 32 N 0.22 2.59 0.27 0.00 2.01 -1.26 -0.91 115.64 118.56 2yrt s THR 32 Ca -0.12 -2.25 0.02 0.00 0.31 0.00 0.00 61.69 59.65 2yrt s THR 32 Cb -0.16 -2.86 -0.01 0.00 0.01 0.00 0.00 72.50 69.48 2yrt s THR 32 CO 0.06 -0.62 0.06 0.00 -0.69 0.00 0.00 174.62 173.43 2yrt n TYR 33 N 4.36 0.28 -3.98 4.92 4.11 -1.16 -3.44 117.16 122.25 2yrt n TYR 33 Ca 0.02 -1.57 -0.33 0.00 -0.00 0.00 0.00 57.90 56.02 2yrt n TYR 33 Cb 0.42 -0.06 -0.14 0.00 -0.00 0.00 0.00 39.34 39.55 2yrt n TYR 33 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.86 175.85 2yrt s HIS 34 N -2.36 3.41 -2.00 -3.48 3.76 0.16 -2.11 115.29 112.66 2yrt s HIS 34 Ca 0.09 -2.34 0.11 0.00 -0.15 0.00 0.00 55.06 52.77 2yrt s HIS 34 Cb 0.00 -2.33 0.66 0.00 1.11 0.00 0.00 32.58 32.03 2yrt s HIS 34 CO 0.06 -0.88 1.10 -0.35 -0.85 0.00 0.00 174.74 173.82 2yrt n PRO 35 N 4.47 0.49 0.00 8.40 -0.04 -1.26 -4.61 135.00 142.44 2yrt n PRO 35 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 2yrt n PRO 35 Cb 0.42 -1.36 0.00 0.00 -0.04 0.00 0.00 33.50 32.53 2yrt n PRO 35 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2yrt n GLY 36 N -0.02 2.23 3.10 0.55 0.00 -1.26 -4.98 105.19 104.80 2yrt n GLY 36 Ca 0.08 -1.86 -0.10 0.00 0.00 0.00 0.00 46.02 44.14 2yrt n GLY 36 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2yrt s VAL 37 N 3.28 0.47 -0.48 1.61 -7.23 -1.26 -4.94 120.40 111.85 2yrt s VAL 37 Ca 0.00 -1.53 -0.27 0.00 -1.81 0.00 0.00 61.98 58.36 2yrt s VAL 37 Cb 0.00 -1.16 -0.02 0.00 0.56 0.00 0.00 36.38 35.77 2yrt s VAL 37 CO 0.00 -0.72 1.78 -2.16 -0.31 0.00 0.00 175.10 173.70 2yrt s PRO 38 N -2.91 3.01 -0.02 4.82 0.04 -1.26 -2.43 135.00 136.25 2yrt s PRO 38 Ca 0.01 0.96 -0.02 0.00 0.04 0.00 0.00 61.00 61.98 2yrt s PRO 38 Cb -0.00 -4.27 -0.04 0.00 0.04 0.00 0.00 34.50 30.22 2yrt s PRO 38 CO -0.04 -2.26 0.14 0.54 0.04 0.00 0.00 177.00 175.42 2yrt s VAL 39 N 7.81 5.16 -0.34 -0.36 0.11 -1.11 -4.94 120.40 126.73 2yrt s VAL 39 Ca 0.71 -0.22 -0.01 0.00 -2.93 0.00 0.00 61.98 59.53 2yrt s VAL 39 Cb -0.16 -3.37 0.12 0.00 -1.53 0.00 0.00 36.38 31.43 2yrt s VAL 39 CO 0.27 0.37 0.17 -0.36 -3.33 0.00 0.00 175.10 172.22 2yrt s PHE 40 N -1.24 0.94 -0.06 1.54 0.08 -1.26 -0.04 117.98 117.95 2yrt s PHE 40 Ca 0.24 -1.52 0.05 0.00 0.12 0.00 0.00 56.93 55.82 2yrt s PHE 40 Cb -0.12 -1.18 -0.00 0.00 -0.57 0.00 0.00 43.02 41.14 2yrt s PHE 40 CO 0.15 -0.83 -0.21 -3.38 -0.10 0.00 0.00 175.22 170.85 2yrt s HIS 41 N 1.38 2.06 -1.46 0.36 -3.43 -0.68 -4.74 115.29 108.78 2yrt s HIS 41 Ca 0.14 -0.64 -0.08 0.00 -0.80 0.00 0.00 55.06 53.67 2yrt s HIS 41 Cb -0.20 -1.37 0.05 0.00 -1.43 0.00 0.00 32.58 29.63 2yrt s HIS 41 CO -0.15 -0.22 0.83 -0.25 -2.00 0.00 0.00 174.74 172.95 2yrt n ASP 42 N 3.15 -3.16 0.00 7.38 9.92 -1.26 0.52 116.55 133.10 2yrt n ASP 42 Ca -0.18 -0.82 0.00 0.00 -0.53 0.00 0.00 54.79 53.25 2yrt n ASP 42 Cb 0.52 -3.81 0.00 0.00 -0.64 0.00 0.00 41.12 37.19 2yrt n ASP 42 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2yrt n ALA 43 N -4.51 0.00 -3.17 2.24 0.00 -1.26 -4.92 120.51 108.88 2yrt n ALA 43 Ca -0.10 0.00 -0.45 0.00 0.00 0.00 0.00 53.44 52.89 2yrt n ALA 43 Cb 0.59 -0.75 -0.04 0.00 0.00 0.00 0.00 19.45 19.24 2yrt n ALA 43 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2yrt s LEU 44 N 0.00 5.73 -0.16 0.00 1.43 0.18 -4.06 118.68 121.81 2yrt s LEU 44 Ca 0.00 -1.71 -0.17 0.00 -1.03 0.00 0.00 54.13 51.22 2yrt s LEU 44 Cb 0.00 -2.27 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 2yrt s LEU 44 CO 0.00 -0.99 0.43 -0.54 0.23 0.00 0.00 176.35 175.48 2yrt s LYS 45 N 2.12 4.27 0.00 1.70 1.02 0.10 -1.69 119.74 127.25 2yrt s LYS 45 Ca 0.11 0.32 0.00 0.00 0.02 0.00 0.00 55.97 56.42 2yrt s LYS 45 Cb -0.23 -3.47 0.00 0.00 -0.52 0.00 0.00 37.83 33.61 2yrt s LYS 45 CO 0.03 0.09 0.00 0.41 -0.92 0.00 0.00 175.35 174.95 2yrt n GLY 46 N 3.53 2.65 3.50 -3.33 0.00 0.95 -2.22 105.19 110.27 2yrt n GLY 46 Ca -0.08 0.12 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 2yrt n GLY 46 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2yrt s TRP 47 N 1.89 -0.62 -1.91 1.61 0.52 -1.19 -2.75 118.94 116.49 2yrt s TRP 47 Ca 0.00 1.24 0.00 0.00 0.02 0.00 0.00 56.10 57.36 2yrt s TRP 47 Cb 0.00 0.32 0.00 0.00 -1.15 0.00 0.00 33.47 32.64 2yrt s TRP 47 CO 0.00 -0.50 0.93 0.45 0.02 0.00 0.00 176.95 177.85 2yrt n SER 48 N 1.55 0.09 -0.12 2.95 2.88 -1.02 -3.25 113.62 116.70 2yrt n SER 48 Ca -0.18 -1.95 -0.17 0.00 -1.33 0.00 0.00 58.87 55.24 2yrt n SER 48 Cb 0.56 -0.04 -0.13 0.00 -0.75 0.00 0.00 64.21 63.85 2yrt n SER 48 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2yrt n LYS 51 N -0.73 0.96 -1.68 0.00 5.02 -1.26 -4.48 118.16 115.99 2yrt n LYS 51 Ca -0.03 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.84 2yrt n LYS 51 Cb 0.66 -1.22 -0.03 0.00 -0.02 0.00 0.00 35.03 34.42 2yrt n LYS 51 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2yrt s ARG 52 N -2.00 3.97 -0.22 1.97 3.00 -1.26 -4.96 118.95 119.46 2yrt s ARG 52 Ca 0.20 2.49 -0.09 0.00 -1.00 0.00 0.00 55.73 57.34 2yrt s ARG 52 Cb 0.09 -4.19 0.09 0.00 0.00 0.00 0.00 34.95 30.94 2yrt s ARG 52 CO 0.16 -1.14 0.49 0.50 0.00 0.00 0.00 175.30 175.30 2yrt s ARG 53 N 4.76 0.43 0.20 5.12 6.06 -1.26 -3.20 118.95 131.06 2yrt s ARG 53 Ca 0.90 1.05 0.06 0.00 -2.50 0.00 0.00 55.73 55.24 2yrt s ARG 53 Cb -0.41 0.29 -0.05 0.00 0.06 0.00 0.00 34.95 34.84 2yrt s ARG 53 CO 0.40 -0.20 -0.10 -0.08 -2.50 0.00 0.00 175.30 172.82 2yrt s THR 54 N 2.18 1.44 -2.37 4.11 -1.32 -0.94 -4.91 115.64 113.83 2yrt s THR 54 Ca -0.06 -2.13 0.22 0.00 -1.21 0.00 0.00 61.69 58.52 2yrt s THR 54 Cb -0.10 -2.08 0.45 0.00 -1.51 0.00 0.00 72.50 69.26 2yrt s THR 54 CO -0.15 -0.56 1.44 0.35 -2.21 0.00 0.00 174.62 173.49 2yrt n THR 55 N -0.36 0.50 -4.73 5.08 -2.24 -1.26 -0.72 114.28 110.55 2yrt n THR 55 Ca -0.08 -0.68 -0.33 0.00 -2.27 0.00 0.00 64.05 60.69 2yrt n THR 55 Cb 0.61 0.77 -0.12 0.00 -2.10 0.00 0.00 70.33 69.49 2yrt n THR 55 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2yrt s ASP 56 N -1.42 4.36 -0.03 3.42 1.11 -1.26 -4.91 116.67 117.93 2yrt s ASP 56 Ca 0.38 -0.13 -0.25 0.00 0.18 0.00 0.00 52.55 52.73 2yrt s ASP 56 Cb 0.22 -1.14 -0.20 0.00 1.07 0.00 0.00 42.92 42.87 2yrt s ASP 56 CO 0.30 0.32 1.21 0.15 1.18 0.00 0.00 175.17 178.33 2yrt h PHE 57 N 5.53 0.09 -0.10 4.23 3.57 -1.93 -2.15 116.94 126.19 2yrt h PHE 57 Ca -0.44 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.02 2yrt h PHE 57 Cb 1.17 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.89 2yrt h PHE 57 CO 0.53 0.62 0.05 1.03 -2.23 0.00 0.00 178.31 178.32 2yrt h SER 58 N -0.46 0.12 0.51 0.41 0.87 -2.01 -1.59 113.55 111.39 2yrt h SER 58 Ca 0.00 -0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.36 2yrt h SER 58 Cb 0.62 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 2yrt h SER 58 CO 0.01 0.10 -0.87 -0.78 -0.53 0.00 0.00 176.83 174.76 2yrt h ASP 59 N 0.14 0.32 -1.00 6.23 1.82 -1.97 -3.23 116.42 118.73 2yrt h ASP 59 Ca 0.04 -0.26 0.16 0.00 -0.39 0.00 0.00 57.03 56.58 2yrt h ASP 59 Cb 0.01 -0.10 -0.10 0.00 0.68 0.00 0.00 39.33 39.82 2yrt h ASP 59 CO -0.01 1.05 0.62 0.15 -1.61 0.00 0.00 179.24 179.44 2yrt h PHE 60 N 0.14 1.09 0.00 0.28 3.57 -0.59 0.29 116.94 121.73 2yrt h PHE 60 Ca -0.05 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 2yrt h PHE 60 Cb 1.49 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.89 2yrt h PHE 60 CO 0.04 0.33 -0.22 -0.07 -2.23 0.00 0.00 178.31 176.16 2yrt h LEU 61 N 0.86 0.00 -1.06 0.59 3.38 -1.57 -3.00 115.31 114.52 2yrt h LEU 61 Ca 0.54 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.41 2yrt h LEU 61 Cb 0.72 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2yrt h LEU 61 CO -0.32 0.22 -0.47 -1.28 0.09 0.00 0.00 178.44 176.67 2yrt h SER 62 N 0.00 0.00 -1.17 -0.43 0.87 -0.46 -3.45 113.55 108.90 2yrt h SER 62 Ca -0.00 0.00 -0.76 0.00 -1.23 0.00 0.00 61.79 59.80 2yrt h SER 62 Cb 0.86 0.00 0.05 0.00 -0.44 0.00 0.00 62.40 62.87 2yrt h SER 62 CO 0.03 0.47 0.17 -0.38 -0.53 0.00 0.00 176.83 176.58 2yrt n ILE 63 N -3.96 0.00 -3.82 2.23 5.41 -1.00 -4.93 119.36 113.28 2yrt n ILE 63 Ca -0.02 -0.00 -0.34 0.00 1.00 0.00 0.00 62.75 63.40 2yrt n ILE 63 Cb 0.49 -0.22 -0.05 0.00 -0.71 0.00 0.00 39.64 39.15 2yrt n ILE 63 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2yrt s VAL 64 N 0.17 5.35 0.20 1.39 1.01 -1.26 -4.86 120.40 122.40 2yrt s VAL 64 Ca 0.90 -0.01 -0.31 0.00 0.00 0.00 0.00 61.98 62.56 2yrt s VAL 64 Cb -1.19 -3.56 -0.16 0.00 0.00 0.00 0.00 36.38 31.47 2yrt s VAL 64 CO 0.55 0.31 0.93 0.61 0.00 0.00 0.00 175.10 177.50 2yrt n GLY 65 N 0.91 -0.56 0.00 4.51 0.00 -1.22 -4.88 105.19 103.96 2yrt n GLY 65 Ca -0.10 0.43 0.11 0.00 0.00 0.00 0.00 46.02 46.46 2yrt n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yrt s THR 67 N -3.04 3.29 0.01 0.00 2.01 -0.90 -5.01 115.64 112.00 2yrt s THR 67 Ca 0.07 -1.53 0.06 0.00 0.31 0.00 0.00 61.69 60.61 2yrt s THR 67 Cb 0.16 -3.09 -0.02 0.00 0.01 0.00 0.00 72.50 69.57 2yrt s THR 67 CO 0.84 -0.18 -0.19 -0.54 -0.69 0.00 0.00 174.62 173.86 2yrt s LYS 68 N -3.92 1.43 0.00 4.92 -0.14 -1.26 -2.98 119.74 117.79 2yrt s LYS 68 Ca 0.39 -0.76 0.00 0.00 -1.36 0.00 0.00 55.97 54.25 2yrt s LYS 68 Cb -0.04 -1.44 0.00 0.00 -1.68 0.00 0.00 37.83 34.67 2yrt s LYS 68 CO 0.25 0.38 0.00 0.41 -0.76 0.00 0.00 175.35 175.63 2yrt n GLY 69 N 2.34 1.30 3.49 -3.33 0.00 0.46 -4.76 105.19 104.68 2yrt n GLY 69 Ca -0.16 -0.25 -0.34 0.00 0.00 0.00 0.00 46.02 45.27 2yrt n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2yrt s ARG 70 N 2.27 3.67 0.32 1.61 0.52 -1.07 -1.11 118.95 125.17 2yrt s ARG 70 Ca 0.00 -0.51 -0.27 0.00 -0.52 0.00 0.00 55.73 54.43 2yrt s ARG 70 Cb 0.00 -2.98 -0.13 0.00 0.52 0.00 0.00 34.95 32.36 2yrt s ARG 70 CO 0.00 0.17 0.92 0.72 0.02 0.00 0.00 175.30 177.13 2yrt n HIS 71 N 3.76 0.92 -3.40 -0.53 8.25 -1.26 -4.93 115.22 118.03 2yrt n HIS 71 Ca -0.17 0.68 -0.44 0.00 -0.26 0.00 0.00 57.72 57.53 2yrt n HIS 71 Cb 0.52 -2.19 -0.09 0.00 1.12 0.00 0.00 29.99 29.35 2yrt n HIS 71 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2yrt s ASN 72 N -0.67 6.14 0.00 0.41 -0.87 -1.26 -4.91 114.94 113.78 2yrt s ASN 72 Ca 0.60 -1.01 0.04 0.00 -1.57 0.00 0.00 52.86 50.92 2yrt s ASN 72 Cb -0.68 -2.19 0.17 0.00 -0.02 0.00 0.00 41.25 38.53 2yrt s ASN 72 CO 0.59 -0.56 1.12 -1.54 -2.57 0.00 0.00 177.10 174.13 2yrt n SER 73 N 5.30 0.35 -4.09 -1.22 3.41 -1.26 0.40 113.62 116.51 2yrt n SER 73 Ca -0.11 -1.94 -0.31 0.00 -0.26 0.00 0.00 58.87 56.25 2yrt n SER 73 Cb 0.46 -0.04 -0.16 0.00 -0.26 0.00 0.00 64.21 64.20 2yrt n SER 73 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2yrt s GLU 74 N -1.92 2.59 0.00 4.33 8.01 -1.26 -4.89 118.70 125.56 2yrt s GLU 74 Ca 0.07 -0.69 0.00 0.00 0.01 0.00 0.00 54.97 54.36 2yrt s GLU 74 Cb 0.04 -2.22 0.00 0.00 -4.31 0.00 0.00 34.13 27.64 2yrt s GLU 74 CO 0.05 -0.12 0.28 1.63 0.01 0.00 0.00 175.26 177.10